Bulletin of the Korean Chemical Society

  • 제26권4호
  • /
  • Pages.629-633
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  • 2005
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  • 0253-2964(pISSN)
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  • 1229-5949(eISSN)
대한화학회 (Korean Chemical Society)
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Linear Correlation Equation for Retention Factor of Nucleic Acid Using QSPR

  • Zheng, Jinzhu (Department of Chemical Engineering, Inha University) ;
  • Han, Soon-Koo (Department of Chemical Engineering, Inha University) ;
  • Row, Kyung-Ho (Department of Chemical Engineering, Inha University)
  • 발행 : 2005.04.20
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초록

In the reversed-phase chromatography, the retention time of sample was investigated based on the molecular structure of compound. Several descriptors that were related to retention factors were selected, and then the values of descriptors were calculated with several softwares. The effect of retention factor was measured with calculated values, and the results were obtained that each descriptors of molecular structure of compound have different effect on the retention factor. Therefore, the empirical equation for seven types of descriptors considered was obtained, and it has high values of correlation coefficient. Furthermore, the experimental data and calculated values have good agreement.

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참고문헌

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피인용 문헌

  1. Synthesis and QSRR Study for a Series of Phosphoramidic Acid Derivatives vol.24, pp.2, 2013, https://doi.org/10.1002/hc.21076
  2. Retention of Large Biological Molecules by Size-Exclusion Chromatography vol.50, pp.6, 2017, https://doi.org/10.1080/00032719.2016.1205082
  3. Prediction of Retention of Nucleic Compounds Based on a QSPR Model vol.64, pp.3-4, 2006, https://doi.org/10.1365/s10337-006-0840-8
  4. Molecular modeling of wine polyphenols vol.46, pp.3, 2009, https://doi.org/10.1007/s10910-009-9552-2
  5. Using linear solvation energy relationship model to study the retention factor of solute in liquid chromatography vol.25, pp.12, 2005, https://doi.org/10.1002/poc.3027
  6. ABEEM/MM OH- Models for OH-(H2O)n Clusters and Aqueous OH-: Structures, Charge Distributions, and Binding Energies vol.124, pp.28, 2005, https://doi.org/10.1021/acs.jpca.0c03941